Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28152232 | 0.87 | PTGS2 (0.47) | PTGS2PTGS1 | |
| SCHEMBL27692614 | 0.83 | PTGS2 (0.54) | PTGS2PTGS1 | |
| SCHEMBL5309162 | 0.76 | PTGS2 (0.61) | PTGS2PTGS1 | |
| SCHEMBL28766837 | 0.75 | PTGS2 (0.62) | PTGS2PTGS1 | |
| SCHEMBL5594090 | 0.70 | PTGS2 (0.76) | PTGS2PTGS1 | |
| SCHEMBL27508363 | 0.70 | PTGS2 (0.47) | PTGS2PTGS1 | |
| SCHEMBL5316308 | 0.69 | PTGS2 (0.64) | PTGS2PTGS1 | |
| SCHEMBL5312580 | 0.68 | PTGS2 (0.59) | PTGS2PTGS1 | |
| SCHEMBL5204407 | 0.66 | PTGS2 (0.53) | PTGS2PTGS1 | |
| SCHEMBL28480909 | 0.65 | KIF11 (0.40) | PTGS2PTGS1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102186817-B | Atropisomers of (hydroxyalkyl) pyrrole derivatives | 埃克塞利希斯股份有限公司 | 2017-05-17 | — | — | CN | disclosed |